SCHEMBL26143787

SCHEMBL26143787

Clc1nc(N2CCOCC2)nc(Cl)c1-c1ccc2c(c1)OCO2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ PIK3CA P42336 4/20 0.47
▸ PIK3CG P48736 3/20 0.47
▸ MTOR P42345 2/20 0.47
▸ ALDH1A1 P00352 6/20 0.46
▸ MAPT P10636 3/20 0.46
▸ ADK P55263 2/20 0.44
▸ PIK3CB P42338 2/20 0.44
▸ NPC1 O15118 4/20 0.44
▸ SMN1; SMN2 Q16637 4/20 0.44
▸ RAB9A P51151 3/20 0.44
▸ TP53 P04637 2/20 0.44
▸ HPGD P15428 2/20 0.44
▸ KDM4E B2RXH2 2/20 0.43
▸ PIK3R1 P27986 1/20 0.42
▸ PIK3CD O00329 1/20 0.42
▸ FLT3 P36888 1/20 0.41
▸ GAA P10253 2/20 0.41
▸ ALOX15 P16050 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL26143786 0.84 KMT2A (0.55) KMT2AMEN1PIK3CAPIK3CGMTOR
SCHEMBL26143788 0.82 MEN1 (0.44) KMT2AMEN1PIK3CAPIK3CGMTOR
SCHEMBL11863334 0.79 KMT2A (0.57) KMT2AMEN1PIK3CAPIK3CGMTOR
SCHEMBL26143793 0.76 KDM4E (0.54) KMT2AMEN1ALDH1A1MAPTNPC1
SCHEMBL3724689 0.74 MEN1 (0.50) KMT2AMEN1PIK3CAPIK3CGMTOR
SCHEMBL22404289 0.72 CLK4 (0.50) KMT2APIK3CAPIK3CGALDH1A1MAPT
SCHEMBL29345068 0.71 MAPT (0.64) KMT2AMEN1MAPTSMN1; SMN2TP53
SCHEMBL18674639 0.70 AR (0.65) KMT2AMEN1ALDH1A1MAPTNPC1
SCHEMBL19500868 0.69 MAPT (0.59) KMT2AMEN1ALDH1A1MAPTNPC1
SCHEMBL28609409 0.69 MTOR (0.72) PIK3CAPIK3CGMTORPIK3CBPIK3CD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023078463-A1 AZOBENZENE COMPOUND AND APPLICATION THEREOF 正大天晴药业集团股份有限公司 2023-05-11 — — WO disclosed
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